3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

C27H23N5 — CID 143495210

About 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine

3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 143495210) has the molecular formula C27H23N5 and a molecular weight of 417.52 g/mol. Its IUPAC name is 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

• Compound Name: 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
• PubChem CID: 143495210
• Molecular Formula: C27H23N5
• Molecular Weight: 417.52 g/mol
• Exact Mass: 417.20
• IUPAC Name: 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
• SMILES: Nc1nccn2c(C3=CCCCC3)nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c12
• InChI: InChI=1S/C27H23N5/c28-26-25-24(31-27(32(25)16-15-29-26)20-9-5-2-6-10-20)21-12-11-19-13-14-22(30-23(19)17-21)18-7-3-1-4-8-18/h1,3-4,7-9,11-17H,2,5-6,10H2,(H2,28,29)
• InChIKey: WIFOKFHJYWYEMC-UHFFFAOYSA-N
• XLogP: 6.15
• TPSA: 69.10 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 5
• Rotatable Bonds: 3
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	417.52
LogP ≤ 5	6.15
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?

The IUPAC name of 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine (CID 143495210) is 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine.

What is the SMILES notation for 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?

The canonical SMILES for 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is Nc1nccn2c(C3=CCCCC3)nc(-c3ccc4ccc(-c5ccccc5)nc4c3)c12.

What is the InChIKey of 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?

The InChIKey is WIFOKFHJYWYEMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H23N5/c28-26-25-24(31-27(32(25)16-15-29-26)20-9-5-2-6-10-20)21-12-11-19-13-14-22(30-23(19)17-21)18-7-3-1-4-8-18/h1,3-4,7-9,11-17H,2,5-6,10H2,(H2,28,29).

What are the key properties of 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine?

3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 417.52 g/mol, XLogP of 6.15, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(cyclohexen-1-yl)-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 143495210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).